1,4-Dioxane → 2,2-Dimethyl-4-(1-oxoisoindolin-2-yl)-6-trifluoromethylsulfonyl-2H-1-benzopyran

반응식

[CH3:1][C:2]1([CH3:30])[O:3][c:4]2[c:5]([cH:19][c:20]([S:23](=[O:24])(=[O:25])[C:26]([F:27])([F:28])[F:29])[cH:21][cH:22]2)[CH:6]([N:9]2[C:10](=[O:18])[c:11]3[cH:12][cH:13][cH:14][cH:15][c:16]3[CH2:17]2)[CH:7]1[OH:8].[O:31]1[CH2:32][CH2:33][O:34][CH2:35][CH2:36]1>>[CH3:1][C:2]1([CH3:30])[O:3][c:4]2[c:5]([cH:19][c:20]([S:23](=[O:24])(=[O:25])[C:26]([F:27])([F:28])[F:29])[cH:21][cH:22]2)[C:6]([N:9]2[C:10](=[O:18])[c:11]3[cH:12][cH:13][cH:14][cH:15][c:16]3[CH2:17]2)=[CH:7]1

참가 물질

반응물 2

HCID 312751,4-Dioxane

HCID 147482452-[3-hydroxy-2,2-dimethyl-6-(trifluoromethylsulfonyl)-3,4-dihydrochromen-4-yl]-3H-isoindol-1-one

생성물 1

HCID 197881002,2-Dimethyl-4-(1-oxoisoindolin-2-yl)-6-trifluoromethylsulfonyl-2H-1-benzopyran

출처 및 근거

ORD 기록: ord-1827ea41b748428f8ca5a4b79183a992
출처 데이터셋: Training data from https://doi.org/10.1039/C8SC04228D (8/10)
DOI: 10.1039/C8SC04228D

반응 노트

불러오는 중…